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Home > Bromides > 1017782-91-0
1017782-91-0 | Methanone, (5-bromo-3-pyridinyl)-1-piperazinyl-
CAS No: 1017782-91-0 Catalog No: AG0005JH MDL No:MFCD09972258
Product Description
Catalog Number:
AG0005JH
Chemical Name:
Methanone, (5-bromo-3-pyridinyl)-1-piperazinyl-
CAS Number:
1017782-91-0
Molecular Formula:
C10H12BrN3O
Molecular Weight:
270.1258
MDL Number:
MFCD09972258
IUPAC Name:
(5-bromopyridin-3-yl)-piperazin-1-ylmethanone
InChI:
InChI=1S/C10H12BrN3O/c11-9-5-8(6-13-7-9)10(15)14-3-1-12-2-4-14/h5-7,12H,1-4H2
InChI Key:
LRCQANGFZMRSDK-UHFFFAOYSA-N
SMILES:
Brc1cncc(c1)C(=O)N1CCNCC1
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.016g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.13g/mol
Monoisotopic Mass:
269.016g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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